N-(1,3-benzothiazol-2-ylmethyl)-4-chloranyl-N-methyl-2-nitro-aniline

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloranyl-N-methyl-2-nitro-aniline Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-N-methyl-2-nitro-aniline CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-N-methyl-2-nitroaniline IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-4-chloro-N-methyl-2-nitroaniline Traditional Name: 1,3-benzothiazol-2-ylmethyl-(4-chloro-2-nitro-phenyl)-methyl-amine Formula: C15H12ClN3O2S MolecularWeight: 333.79268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClN3O2S/c1-18(12-7-6-10(16)8-13(12)19(20)21)9-15-17-11-4-2-3-5-14(11)22-15/h2-8H,9H2,1H3